1-[4-[4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-[4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-chloro-3-indolin-1-ylsulfonyl-benzoyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[[4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]piperazin-1-yl]ethanone Traditional Name: 1-[4-(4-chloro-3-indolin-1-ylsulfonyl-benzoyl)piperazino]ethanone Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H22ClN3O4S/c1-15(26)23-10-12-24(13-11-23)21(27)17-6-7-18(22)20(14-17)30(28,29)25-9-8-16-4-2-3-5-19(16)25/h2-7,14H,8-13H2,1H3